CID 45055008

2-(((2-(4-(dimethylamino)benzylidene)hydrazino)(oxo)ac)amino)-n-phenylbenzamide

Structural Information

Molecular Formula
C24H23N5O3
SMILES
CN(C)C1=CC=C(C=C1)/C=N/NC(=O)C(=O)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3
InChI
InChI=1S/C24H23N5O3/c1-29(2)19-14-12-17(13-15-19)16-25-28-24(32)23(31)27-21-11-7-6-10-20(21)22(30)26-18-8-4-3-5-9-18/h3-16H,1-2H3,(H,26,30)(H,27,31)(H,28,32)/b25-16+
InChIKey
QHHMWMFEVONQEQ-PCLIKHOPSA-N
Compound name
N'-[(E)-[4-(dimethylamino)phenyl]methylideneamino]-N-[2-(phenylcarbamoyl)phenyl]oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.18008 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.18736 203.5
[M+Na]+ 452.16930 204.9
[M-H]- 428.17280 214.9
[M+NH4]+ 447.21390 211.6
[M+K]+ 468.14324 202.6
[M+H-H2O]+ 412.17734 191.6
[M+HCOO]- 474.17828 230.9
[M+CH3COO]- 488.19393 244.0
[M+Na-2H]- 450.15475 206.2
[M]+ 429.17953 202.9
[M]- 429.18063 202.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.